SCHEMBL266683

SCHEMBL266683

O=C(Nc1ccccc1C(=O)NN=Cc1cccc(F)c1)c1cccc(F)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.62
RAB9A P51151 7/20 0.62
PKM P14618 6/20 0.62
MAPT P10636 4/20 0.62
ALDH1A1 P00352 1/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
TDP1 Q9NUW8 2/20 0.57
KMT2A Q03164 6/20 0.57
MEN1 O00255 5/20 0.57
GAA P10253 2/20 0.54
MGAM O43451 1/20 0.54
SI P14410 1/20 0.54
MGAM2 Q2M2H8 1/20 0.54
SLC34A2 O95436 1/20 0.54
SLC34A1 Q06495 1/20 0.54
SLC34A3 Q8N130 1/20 0.54
SLC20A1 Q8WUM9 1/20 0.54
POLB P06746 2/20 0.54
CTDSP1 Q9GZU7 1/20 0.54
NPSR1 Q6W5P4 1/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL266682 1.00 NPC1 (0.62) NPC1RAB9APKMMAPTALDH1A1
SCHEMBL266752 0.95 RAB9A (0.69) NPC1RAB9APKMMAPTALDH1A1
SCHEMBL266751 0.95 RAB9A (0.69) NPC1RAB9APKMMAPTALDH1A1
SCHEMBL266071 0.94 NPSR1 (0.62) NPC1RAB9APKMMAPTALDH1A1
SCHEMBL266072 0.94 NPSR1 (0.62) NPC1RAB9APKMMAPTALDH1A1
SCHEMBL265443 0.92 RAB9A (0.56) NPC1RAB9APKMMAPTALDH1A1
SCHEMBL265442 0.92 RAB9A (0.56) NPC1RAB9APKMMAPTALDH1A1
SCHEMBL266886 0.92 MAPT (0.69) NPC1RAB9APKMMAPTALDH1A1
SCHEMBL266887 0.92 MAPT (0.69) NPC1RAB9APKMMAPTALDH1A1
SCHEMBL266464 0.92 RAB9A (0.65) NPC1RAB9APKMMAPTALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-05-10 US disclosed
US-8134015-B2 Compound inhibiting in vivo phosphorous transport and medicine containing the same KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-03-13 US disclosed
US-20060217426-A1 Compound inhibiting in vivo phosphorous transport and medicine containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-09-28 US disclosed
EP-1614676-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2006-01-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060217426-A1 Compound inhibiting in vivo phosphorous transport and medicine containing the same SLC10A6, SLC7A1, SLC10A1 NPC1 102/4885RAB9A 883/4885PKM 1697/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 NPC1 115/4885RAB9A 1362/4885PKM 1916/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.